Found 54 results

Search term: MF = 'C_{33}H_{48}O_{5}'
ChemSpider 2D Image | (3beta,16beta,25R)-23-Vinyl-22,27-epoxycholesta-5,22-diene-3,16-diyl diacetate | C33H48O5

(3β,16β,25R)-23-Vinyl-22,27-epoxycholesta-5,22-diene-3,16-diyl diacetate

  • Molecular FormulaC33H48O5
  • Average mass524.731 Da
  • Monoisotopic mass524.350159 Da
  • ChemSpider ID9343536

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(3β,16β,25R)-23-Vinyl-22,27-epoxycholesta-5,22-dien-3,16-diyl-diacetat [German] [ACD/IUPAC Name]
(3β,16β,25R)-23-Vinyl-22,27-epoxycholesta-5,22-diene-3,16-diyl diacetate [ACD/IUPAC Name]
Cholesta-5,22-diene-3,16-diol, 22,26-epoxy-23-ethenyl-, diacetate, (3β,16β,25R)- [ACD/Index Name]
Diacétate de (3β,16β,25R)-23-vinyl-22,27-époxycholesta-5,22-diène-3,16-diyle [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 590.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.1±3.0 kJ/mol
Flash Point: 244.9±30.2 °C
Index of Refraction: 1.543
Molar Refractivity: 148.8±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 7.89
ACD/LogD (pH 5.5): 7.46
ACD/BCF (pH 5.5): 273190.91
ACD/KOC (pH 5.5): 271017.13
ACD/LogD (pH 7.4): 7.46
ACD/BCF (pH 7.4): 273190.91
ACD/KOC (pH 7.4): 271017.13
Polar Surface Area: 62 Å2
Polarizability: 59.0±0.5 10-24cm3
Surface Tension: 42.4±5.0 dyne/cm
Molar Volume: 472.5±5.0 cm3

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